200,000+ products from a single source!
sales@angenechem.com
141763-22-6 | Thiazolo[5,4-d]pyrimidin-7(4H)-one, 2-[(phenylmethyl)thio]-
CAS No: 141763-22-6 Catalog No: AG001H0R MDL No:
Product Description
Catalog Number:
AG001H0R
Chemical Name:
Thiazolo[5,4-d]pyrimidin-7(4H)-one, 2-[(phenylmethyl)thio]-
CAS Number:
141763-22-6
Molecular Formula:
C12H9N3OS2
Molecular Weight:
275.3494
IUPAC Name:
2-benzylsulfanyl-6H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
InChI:
InChI=1S/C12H9N3OS2/c16-10-9-11(14-7-13-10)18-12(15-9)17-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14,16)
InChI Key:
YIQWITJCAXQADV-UHFFFAOYSA-N
SMILES:
O=c1nc[nH]c2c1nc(s2)SCc1ccccc1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.019g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.344g/mol
Monoisotopic Mass:
275.019g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.